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Sugi Predict / Compounds / SCHEMBL10034835

SCHEMBL10034835

SCHEMBL10034835

C[Si](C)(CCCOCC1COC(=O)O1)OCCCCOCC1COC(=O)O1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.36
▸ TDP1 Q9NUW8 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL10034832 0.93 TSHR (0.33) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL12313901 0.89 TSHR (0.37) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL15440624 0.86 TSHR (0.35) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL4122685 0.86 TSHR (0.35) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL15672320 0.86 TSHR (0.35) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL12972095 0.85 TSHR (0.39) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL16675416 0.85 TSHR (0.52) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL14003900 0.83 TSHR (0.50) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL22193341 0.83 TSHR (0.50) TSHRALDH1A1TDP1SMN1; SMN2
SCHEMBL17108348 0.83 TSHR (0.37) TSHRALDH1A1TDP1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9391345-B2 Non-aqueous electrolytes for electrochemical cells UCHICAGO ARGONNE, LLC (US) 2016-07-12 — — US disclosed
US-20120082890-A1 NON-AQUEOUS ELECTROLYTES FOR ELECTROCHEMICAL CELLS UCHICAGO ARGONNE, LLC 2012-04-05 — — US disclosed